F1787-0216
TL;DR: F1787-0216 (CAS 853890-31-0) is a chemical compound with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide
Also Known As: F1787-0216, 7-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide, 7-methyl-1-oxo-N-(4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)isochroman-3-carboxamide, (7-methyl-1-oxoisochroman-3-yl)-N-(4,5,6,7-tetrahydrobenzothiazol-2-yl)carboxa mide, N-(1-thia-3-aza-4,5,6,7-tetrahydro-2-indenyl)-7-methyl-1-oxo-3-isochromancarboxamide
| Molecular Formula | C18H18N2O3S |
|---|---|
| Molecular Weight | 342.10 g/mol |
| LogP | 3.05052 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.10382 |
| Heavy Atoms | 24 |
| Complexity | 804.1665 |
Chemical Identifiers
| CAS Number | 853890-31-0 |
|---|---|
| SMILES | CC1=CC2=C(CC(OC2=O)C(=O)NC3=NC4=C(S3)CCCC4)C=C1 |
Product Overview
F1787-0216 (CAS 853890-31-0), with molecular formula C18H18N2O3S and molecular weight 342.10 g/mol. IUPAC: 7-methyl-1-oxo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide.
Chemical Property Profile of F1787-0216
Property Insights of F1787-0216
The XLogP value of 3.05052 indicates that F1787-0216 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F1787-0216. Following Lipinski's Rule of Five, F1787-0216 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1787-0216?
The CAS number of F1787-0216 is 853890-31-0.
What is the molecular formula of F1787-0216?
The molecular formula of F1787-0216 is C18H18N2O3S.
What is the molecular weight of F1787-0216?
The molecular weight of F1787-0216 is 342.10 g/mol.
Where can I buy F1787-0216?
You can request a quote for F1787-0216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1787-0216?
Yes, KEHONG BIO provides custom synthesis services for F1787-0216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.